Search results for "Benzimidazole"

showing 10 items of 161 documents

Analysis of pesticides in fruits by pressurized liquid extraction and liquid chromatography-ion trap-triple stage mass spectrometry.

2005

A multi-residue method using pressurized liquid extraction (PLE) and liquid chromatography-quadrupole ion trap-triple stage mass spectrometry (LC-IT-MS(3)) has been developed for determining trace levels of pesticides in fruits. The selected pesticides can be distinguished in: benzimidazoles and azoles, organophosphorus, carbamates, neonicotinoids, and acaricides. PLE has been optimized to extract these pesticide residues from oranges and peaches by studying the effect of experimental variables on PLE efficiency. Samples were extracted at high temperature and pressure (75 degrees C and 1500psi) using ethyl acetate as extraction solvent and acidic alumina as drying agent. The recoveries obta…

AzolesEthyl acetateAcetatesMass spectrometryBiochemistryHigh-performance liquid chromatographySensitivity and SpecificityAnabasineMass SpectrometryAnalytical Chemistrychemistry.chemical_compoundOrganophosphorus Compoundsmedia_common.cataloged_instanceEuropean unionPesticidesmedia_commonResidue (complex analysis)ChromatographyPesticide residueChemistryOrganic ChemistryExtraction (chemistry)Pesticide ResiduesTemperatureReproducibility of ResultsGeneral MedicineFruitBenzimidazolesIon trapCarbamatesChromatography LiquidJournal of chromatography. A
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Synthesis and characterisation of N-glycosyl amines from the reaction between 4,6-O-benzylidene-D-glucopyranose and substituted aromatic amines and a…

2001

Twelve N-glycosyl amines were synthesised using 4,6-O–benzylidene-D-glucopyranose and different substituted aromatic amines, including some diamines that resulted in bis-glycosyl amines. Another set of six N–glycosyl amines was synthesised using different hexoses and pentoses and 2–(o–aminophenyl)benzimidazole. All compounds were isolated as solid products and purified, their elemental compositions were established, and these were characterised by NMR (1H and 13C), UV–Vis, and FTIR spectroscopy, by FAB mass spectrometry (molecular-ion peaks gave molecular weights), and by their optical rotations. While the protected saccharide, 4,6-O-benzylidene-D-glucopyranose, exists as a mixture of β and…

BenzimidazoleAnomerGlycosylationOptical RotationNuclear Magnetic Resonance SpectroscopyMolecular Sequence DataPentosesSynthesis (Chemical)macromolecular substancesMass spectrometryBiochemistryMedicinal chemistryMass SpectrometryAnalytical Chemistrychemistry.chemical_compoundOrganic chemistryGlycosylFourier transform infrared spectroscopyAminesPolycyclic Aromatic HydrocarbonsNuclear Magnetic Resonance BiomolecularHexosesMolecular massChemistryChemical shiftOrganic ChemistryHydrogen BondingGeneral MedicineD-GlucopyranoseMolecular WeightGlucoseCarbohydrate Sequencelipids (amino acids peptides and proteins)BenzimidazolesCarbohydrate research
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Discovery of benzimidazole-based Leishmania mexicana cysteine protease CPB2.8ΔCTE inhibitors as potential therapeutics for leishmaniasis

2018

Abstract: Chemotherapy is currently the only effective approach to treat all forms of leishmaniasis. However, its effectiveness is severely limited due to high toxicity, long treatment length, drug resistance, or inadequate mode of administration. As a consequence, there is a need to identify new molecular scaffolds and targets as potential therapeutics for the treatment of this disease. We report a small series of 1,2‐substituted‐1H‐benzo[d]imidazole derivatives (9ad) showing affinity in the submicromolar range (Ki = 0.150.69 μM) toward Leishmania mexicanaCPB2.8ΔCTE, one of the more promising targets for antileishmanial drug design. The compounds confirmed activity in vitro against intrace…

BenzimidazoleCell SurvivalIn silicoLeishmania mexicanaAntiprotozoal AgentsDrug Evaluation PreclinicalProtozoan ProteinsDrug resistanceCysteine Proteinase InhibitorsPharmacologyAntileishmanial agents Benzimidazole derivatives Docking studies In silico profiling Leishmania mexicanaCPB2.8 Biochemistry Molecular Medicine01 natural sciencesBiochemistryLeishmania mexicanaCell LineInhibitory Concentration 50chemistry.chemical_compoundCysteine ProteasesDrug DiscoverymedicineHumansAmastigoteLeishmaniasisBiologyEnzyme AssaysPharmacologyBinding Sitesbiology010405 organic chemistryChemistryPharmacology. TherapyOrganic ChemistryHydrogen BondingLeishmaniasisbiology.organism_classificationmedicine.diseaseLeishmaniaProtein Structure Tertiary0104 chemical sciencesMolecular Docking Simulation010404 medicinal & biomolecular chemistryChemistryMolecular MedicineBenzimidazolesHuman medicineLeishmania infantumChemical biology and drug design
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Pimobendan B from powder diffraction data

2013

The title molecule, C19H18N4O2{systematic name: (RS)-6-[2-(4-methoxyphenyl)-1H-benzimidazol-5-yl]-5-methyl-4,5-dihydropyridazin-3(2H)-one}, adopts an extended conformation. The dihedral angles between the central benzimidazole ring sytem and the pendant methoxyphenyl and pyridazinone residues are 1.41 (18) and 9.7 (3)°, respectively. In the crystal, N—H...N hydrogen bonds link the imadazole groups into [001] chains, and pairs of N—H...O hydrogen bonds link the pyridazinone groups into dimers. Together, these generate a two-dimensional supramolecular structure parallel to (010). The layers are linked by C—H...π interactions.

BenzimidazoleCrystallographyHydrogen bondGeneral ChemistryDihedral angleCondensed Matter PhysicsRing (chemistry)BioinformaticsOrganic PapersCrystalchemistry.chemical_compoundCrystallographychemistryQD901-999General Materials SciencePowder diffractionActa Crystallographica Section E Structure Reports Online
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Synthesis and properties of an Au6 cluster supported by a mixed N-heterocyclic carbene–thiolate ligand

2020

The preparation of a novel Au6 cluster bearing a bidentate mixed carbene–thiolate ligand is presented. The length of linker between the central benzimidazole and thiolate has a strong effect on the formation of cluster products, with a C2 chain giving an Au6 cluster, while a C3 chain results in no evidence of cluster formation. Density functional theory analysis predicts a non-metallic cluster with a large HOMO–LUMO (3.2–3.6 eV) and optical gap.

BenzimidazoleDenticity010405 organic chemistryLigandMetals and AlloysGeneral Chemistry010402 general chemistry01 natural sciencesCatalysis0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic Materialschemistry.chemical_compoundCrystallographychemistryChain (algebraic topology)Materials ChemistryCeramics and CompositesCluster (physics)Density functional theoryCarbeneLinkerChemical Communications
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Silver(I), Copper(I) and Copper(II) Complex of the New N,Se-Chelate Ligand 2-Phenylselenomethyl-1H-benzimidazole: Electrochemistry and Structure

2009

Abstract. 2-Phenylselenomethyl-1H-benzimidazole (psbi) can form complexes in 2:1 ratio with coinage metal ions. Crystal structure analysis revealed a flattened metal coordination for [AgI(psbi)2](BF4) (1), approaching a distorted planar arrangement with weak Ag-Se bonds (d > 2.9 A) and confirmed as energy minimum by DFT calculations. The typical Jahn-Teller system [CuII(psbi)2Cl2] (2) exhibits a planar CuN2Cl2 core with weak Se---Cu---Se axial ligation (3.2944(8) A Cu--Se distance). The oxygen-sensitive compound [CuI(psbi)2](BF4) (3) exhibits electrochemically reversible oxidation in contrast to the silver(I) analogue 1.

BenzimidazoleLigandMetal ions in aqueous solutionInorganic chemistrychemistry.chemical_elementCrystal structureElectrochemistryCopperInorganic ChemistryMetalchemistry.chemical_compoundCrystallographychemistryvisual_artvisual_art.visual_art_mediumChelationZeitschrift für anorganische und allgemeine Chemie
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Highly Stable and Efficient Light-Emitting Electrochemical Cells Based on Cationic Iridium Complexes Bearing Arylazole Ancillary Ligands.

2017

A series of bis-cyclometalated iridium(III) complexes of general formula [Ir(ppy)2(N∧N)][PF6] (ppy− = 2-phenylpyridinate; N∧N = 2-(1H-imidazol-2-yl)pyridine (1), 2-(2-pyridyl)benzimidazole (2), 1-methyl-2-pyridin-2-yl- 1H-benzimidazole (3), 2-(4′-thiazolyl)benzimidazole (4), 1- methyl-2-(4′-thiazolyl)benzimidazole (5)) is reported, and their use as electroluminescent materials in light-emitting electrochemical cell (LEC) devices is investigated. [2][PF6] and [3][PF6] are orange emitters with intense unstructured emission around 590 nm in acetonitrile solution. [1][PF6], [4][PF6], and [5][PF6] are green weak emitters with structured emission bands peaking around 500 nm. The different photoph…

BenzimidazoleLigandchemistry.chemical_element02 engineering and technologyQuímica analíticaElectroluminescence010402 general chemistry021001 nanoscience & nanotechnologyPhotochemistry01 natural sciences0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryPyridineIridiumChemistry AnalyticPhysical and Theoretical ChemistryTriplet state0210 nano-technologyAcetonitrileHOMO/LUMOInorganic chemistry
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Heterocyclic photorearrangements. Photochemical behaviour of some 3,5-disubstituted 1,2,4-oxadiazoles in methanol at 254 nm

1988

Photochemical behaviour of some 3,5-disubstituted 1,2,4-oxadiazoles in methanol at 254 nm has been investigated. Ring photoisomerization to the 1,3,4-oxadiazole heterocycle or formation of open chain compounds involving the nucleophilic solvent was shown to depend on the nature and the position of the substituent. Photoinduced ring closure into the benzimidazole system, involving a 3-N-phenylamino side chain sequence and a photolytic intermediate of the oxadiazole heterocycle, is also reported.

Benzimidazolechemistry.chemical_compoundNucleophilePhotoisomerizationchemistryBicyclic moleculeOrganic ChemistrySide chainSubstituentOxadiazoleRing (chemistry)PhotochemistryJournal of Heterocyclic Chemistry
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ChemInform Abstract: Heterocyclic Photorearrangements. Photochemical Behaviour of Some 3,5-Disubstituted 1,2,4-Oxadiazoles in Methanol at 254 nm.

1989

Photochemical behaviour of some 3,5-disubstituted 1,2,4-oxadiazoles in methanol at 254 nm has been investigated. Ring photoisomerization to the 1,3,4-oxadiazole heterocycle or formation of open chain compounds involving the nucleophilic solvent was shown to depend on the nature and the position of the substituent. Photoinduced ring closure into the benzimidazole system, involving a 3-N-phenylamino side chain sequence and a photolytic intermediate of the oxadiazole heterocycle, is also reported.

Benzimidazolechemistry.chemical_compoundPhotoisomerizationNucleophileChemistrySide chainSubstituentOxadiazoleGeneral MedicineMethanolRing (chemistry)PhotochemistryChemInform
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Antiarrhythmika. I. 2,4-dialkylpyrimido[1,2-a]benzimidazole

1981

Aus der Umsetzung von 2-Aminobenzimidazol (1) mit β-Diketonen (2a-d) gehen die 2,4-Dialkylpyrimido[1,2-a]benzimidazole (3a-d) hervor.

Benzimidazolechemistry.chemical_compoundchemistryOrganic ChemistryMedicinal chemistryJournal of Heterocyclic Chemistry
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